HMDB0061790 RDKit 3D Santolina triene 26 25 0 0 0 0 0 0 0 0999 V2000 -1.3816 1.6149 1.3507 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5661 1.5301 0.3457 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5676 0.4405 -0.6217 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7613 -0.2083 -0.8252 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8467 -0.1414 -0.1396 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0159 0.6517 1.0864 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0731 -0.9162 -0.5849 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6182 -0.5840 -0.4468 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2326 -1.8817 -0.4154 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0696 -0.2678 -0.3712 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3699 2.4461 2.0727 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1085 0.8644 1.5529 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1517 2.3476 0.2319 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7747 0.9388 -1.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8237 -0.8715 -1.7388 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3242 1.7005 0.7902 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1943 0.6152 1.8023 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9123 0.2854 1.6896 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8189 -1.6289 -1.3907 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7746 -0.1715 -1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5762 -1.3945 0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1948 -2.1596 -0.5144 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9643 -2.6685 -0.2894 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5977 -0.7146 -1.2857 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5598 -0.6437 0.5456 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2673 0.8171 -0.4622 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 3 4 1 0 4 5 2 3 5 6 1 0 5 7 1 0 3 8 1 0 8 9 2 3 8 10 1 0 1 11 1 0 1 12 1 0 2 13 1 0 3 14 1 0 4 15 1 0 6 16 1 0 6 17 1 0 6 18 1 0 7 19 1 0 7 20 1 0 7 21 1 0 9 22 1 0 9 23 1 0 10 24 1 0 10 25 1 0 10 26 1 0 M END